2-[2-[2-(3-methyl-2-oxidanylidene-1,3-benzothiazol-6-yl)ethyl-propyl-amino]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(3-methyl-2-oxidanylidene-1,3-benzothiazol-6-yl)ethyl-propyl-amino]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)ethyl-propyl-amino]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)ethyl-propylamino]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)ethyl-propylamino]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(2-keto-3-methyl-1,3-benzothiazol-6-yl)ethyl-propyl-amino]ethyl]isoindoline-1,3-quinone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC1=CC2=C(C=C1)N(C(=O)S2)C)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCN(CCC1=CC2=C(C=C1)N(C(=O)S2)C)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H25N3O3S/c1-3-11-25(12-10-16-8-9-19-20(15-16)30-23(29)24(19)2)13-14-26-21(27)17-6-4-5-7-18(17)22(26)28/h4-9,15H,3,10-14H2,1-2H3